mp_ID stringlengths 4 10 | x float64 -10.28 17.7 | y float64 -12.01 23.9 | z float64 -8.99 7.96 | type stringclasses 2
values | formula stringlengths 2 26 | n_atoms int64 1 444 | spacegroup int64 1 230 | volume float64 5.61 20.1k |
|---|---|---|---|---|---|---|---|---|
mp-849713 | 12.725864 | -0.062456 | -0.052502 | other | Mn12O14F10 | 36 | 1 | 399.8 |
mp-1216469 | -2.777464 | -1.927455 | -5.464947 | other | Yb18B10S42 | 70 | 1 | 1,469.27 |
mp-729405 | -2.422522 | -3.130494 | -5.260522 | other | Pr16S12N8 | 36 | 1 | 828.26 |
mp-714973 | -0.777958 | 0.859549 | -3.755605 | other | K4Nb6Br18 | 28 | 1 | 902.54 |
mp-34982 | -3.999578 | -1.397451 | -5.456341 | other | Ag3Au1S2 | 6 | 1 | 132.71 |
mp-802021 | 7.955072 | 5.339515 | -1.82946 | other | Al8V8O24 | 40 | 1 | 430.76 |
mp-778247 | 12.814466 | 0.856653 | 2.198102 | other | Fe10O6F14 | 30 | 1 | 361.48 |
mp-775001 | 11.314585 | 12.474114 | -3.735547 | other | V3Fe1O8 | 12 | 1 | 224.43 |
mp-675987 | -1.686125 | 0.664909 | -5.206025 | other | Ag7S2I2 | 11 | 1 | 306.13 |
mp-530883 | 9.922142 | 8.548195 | 3.204969 | other | Ce6Y26O51 | 83 | 1 | 1,255.69 |
mp-775842 | 9.708186 | 8.485661 | -0.656177 | other | Bi24B2O39 | 65 | 1 | 1,041.45 |
mp-626299 | 8.309107 | 4.8785 | -3.951659 | other | H20Cl4O24 | 48 | 1 | 516.16 |
mp-1103547 | 8.37375 | 8.046555 | -2.537745 | other | Al2Si2O9 | 13 | 1 | 176 |
mp-776226 | 1.680868 | 1.8056 | 2.954139 | other | Hf16N16O8 | 40 | 1 | 502.04 |
mp-849558 | 10.098795 | 1.139786 | 0.300514 | other | Cr8O2F22 | 32 | 1 | 401.21 |
mp-675499 | 11.308091 | 12.878874 | 0.100795 | other | Ti5Fe7O18 | 30 | 1 | 326.51 |
mp-1179422 | 13.487428 | 7.350719 | -1.163898 | other | Si20H20O30 | 70 | 1 | 1,013.34 |
mp-531997 | 12.103059 | 11.174879 | -1.507479 | other | Na11W16O48 | 75 | 1 | 938.28 |
mp-762575 | 6.349027 | 12.880207 | -1.416237 | other | Li4Fe6O12 | 22 | 1 | 231.72 |
mp-729275 | 10.499709 | 9.351113 | -1.965388 | other | Dy4Te8O22 | 34 | 1 | 508.98 |
mp-655001 | 5.004203 | -0.425932 | -2.962091 | other | Li6B2H12 | 20 | 1 | 175.11 |
mp-1173720 | 8.386601 | 1.120218 | 1.823812 | original | Na1Ho2F7 | 10 | 1 | 154.62 |
mp-2228843 | 10.993442 | 13.187812 | -3.503558 | other | Mg1V5O12 | 18 | 1 | 218.28 |
mp-37430 | 9.992197 | 4.726701 | -6.021309 | other | Na4S2O5 | 11 | 1 | 162.71 |
mp-780519 | 12.932813 | 0.779135 | 1.99081 | other | Fe6O4F8 | 18 | 1 | 216.8 |
mp-1247596 | 7.32825 | 12.260327 | 1.445759 | other | Ca32Mn32O84 | 148 | 1 | 1,849.48 |
mp-705713 | 9.757976 | 8.705175 | -0.579725 | other | Bi14W1O24 | 39 | 1 | 656.65 |
mp-1224420 | 10.573502 | 7.197309 | -5.491823 | other | In2P6O18 | 26 | 1 | 479.22 |
mp-1197475 | 8.709744 | 7.912264 | -2.499295 | other | Mg12Si8O36 | 56 | 1 | 754.49 |
mp-758752 | 7.442638 | 16.827644 | -0.680295 | other | Li10Mn10O24 | 44 | 1 | 415.48 |
mp-1176386 | 6.722611 | 10.380583 | -1.128162 | other | Na32Ni8O32 | 72 | 1 | 1,067.03 |
mp-762250 | 2.544769 | 2.571218 | 1.110263 | other | Sn16N16O8 | 40 | 1 | 533.41 |
mp-760355 | 10.235705 | 2.442505 | 0.079272 | other | V6O2F22 | 30 | 1 | 417.86 |
mp-625671 | 11.698074 | 4.783188 | -4.023291 | other | Mn1H2O2 | 5 | 1 | 48.88 |
mp-626481 | 11.736443 | 4.190588 | -3.763059 | other | Al8H24O24 | 56 | 1 | 423.09 |
mp-757414 | 6.874131 | 13.595307 | -1.911179 | other | Mg4Co14O24 | 42 | 1 | 414.97 |
mp-1217418 | -8.074864 | 1.008636 | -2.819589 | other | Te8Mo4Ru2 | 14 | 1 | 363.55 |
mp-1101127 | 10.733775 | 12.030934 | 1.083244 | other | Ti4Cd2O12 | 18 | 1 | 248.54 |
mp-775786 | 1.6761 | 1.806154 | 2.937794 | other | Hf16N16O8 | 40 | 1 | 502.1 |
mp-773099 | 10.728689 | 9.279763 | 0.188621 | other | Mn4Zn16O20 | 40 | 1 | 508.47 |
mp-755958 | 5.185321 | 11.59594 | -2.335805 | other | Fe6O10F2 | 18 | 1 | 194.78 |
mp-1234003 | 11.857781 | 10.958929 | -2.566226 | other | Mg1Mo6O16 | 23 | 1 | 334.46 |
mp-1178293 | 12.076778 | 1.18657 | 2.631245 | other | Fe10O4F16 | 30 | 1 | 369.2 |
mp-777933 | 13.332441 | 0.465376 | 1.45826 | other | Fe6O5F7 | 18 | 1 | 212.09 |
mp-627077 | 10.701513 | 4.049502 | -3.491906 | other | Ba8H16O16 | 40 | 1 | 526.57 |
mp-850992 | 12.232082 | -0.910678 | 0.889119 | other | Mn12O7F17 | 36 | 1 | 440.93 |
mp-850746 | 13.164171 | 0.591605 | 1.666487 | other | Fe8O6F10 | 24 | 1 | 284.82 |
mp-1176383 | 10.161794 | 12.64878 | -3.987549 | other | Na3V24O58 | 85 | 1 | 1,083.2 |
mp-1216992 | 10.633001 | 10.53227 | -2.074239 | other | V2Bi4O11 | 17 | 1 | 238.12 |
mp-1228770 | 8.240548 | 2.697563 | -1.077685 | other | Au1O2F6 | 9 | 1 | 163.31 |
mp-675858 | -2.923242 | -2.629728 | -5.704844 | other | Lu16Fe8S32 | 56 | 1 | 1,265.28 |
mp-851809 | 7.55762 | 5.123415 | -1.867519 | other | Sn16N16O8 | 40 | 1 | 535.04 |
mp-676545 | 9.675349 | 8.586991 | -0.724781 | other | Cd2Bi36O56 | 94 | 1 | 1,828.83 |
mp-755836 | 11.168134 | 1.694109 | 2.57174 | other | Fe6O1F11 | 18 | 1 | 229.17 |
mp-1041329 | 8.701625 | 14.492224 | -0.243516 | other | Ca6Mn12O24 | 42 | 1 | 537.89 |
mp-765492 | 8.908073 | 14.768989 | -1.049954 | other | Mn11Cu7O24 | 42 | 1 | 461.31 |
mp-1387515 | 6.891542 | 10.851032 | -0.386621 | other | Ca3Co2O6 | 11 | 1 | 219.41 |
mp-752583 | 12.484561 | 12.951211 | -1.87443 | other | Na1V5O10 | 16 | 1 | 192.42 |
mp-1191820 | 13.36523 | 4.513527 | -2.33579 | other | Bi3B6O14 | 23 | 1 | 258.08 |
mp-1177487 | 9.004942 | 12.392115 | -0.132263 | other | Li47Co8O32 | 87 | 1 | 820.13 |
mp-758772 | 5.96065 | 13.158734 | -1.476337 | other | Li16Ni22O44 | 82 | 1 | 743.55 |
mp-1177674 | 8.356845 | 15.549951 | -0.502588 | other | Li12Mn16O32 | 60 | 1 | 603.47 |
mp-780203 | 7.491003 | 12.169908 | -0.782229 | other | Li18Fe4O16 | 38 | 1 | 399.6 |
mp-1345071 | -3.592894 | -2.472596 | -2.919526 | other | Na3V5Se10 | 18 | 1 | 409.72 |
mp-1097052 | 10.971723 | 10.322694 | 1.310777 | other | La2Fe2O5 | 9 | 1 | 126.69 |
mp-675023 | 7.716202 | 12.347196 | -1.259771 | other | Co8Bi5O20 | 33 | 1 | 418.6 |
mp-756720 | 12.716702 | 0.46965 | 0.237161 | other | Fe10O11F9 | 30 | 1 | 342.41 |
mp-778124 | 12.79556 | 0.875314 | 2.186367 | other | Fe10O6F14 | 30 | 1 | 362.18 |
mp-1391065 | 8.080581 | 3.856115 | -1.12857 | other | Li2Fe4F10 | 16 | 1 | 200.07 |
mp-685970 | 9.615242 | 8.586735 | 3.165158 | other | Ce14Gd18O55 | 87 | 1 | 1,317.32 |
mp-1226206 | -2.835395 | -2.464535 | -5.796117 | other | Dy12Ge5S28 | 45 | 1 | 969 |
mp-997539 | 6.337678 | 13.821293 | -2.163458 | other | Li2Co6O12 | 20 | 1 | 212.89 |
mp-627334 | 13.427105 | 7.392871 | -1.16636 | other | Si20H20O30 | 70 | 1 | 980.01 |
mp-778616 | 10.00014 | 12.058036 | -4.63823 | other | V4O8F4 | 16 | 1 | 206.85 |
mp-1331972 | 12.771715 | 10.52193 | 0.283029 | other | Ca6Mo12O24 | 42 | 1 | 591.68 |
mp-1247313 | 1.86012 | 2.299447 | 1.374907 | other | Zn16Ag4N12 | 32 | 1 | 456.51 |
mp-849412 | 10.519138 | 2.259277 | -0.199336 | other | V6O5F19 | 30 | 1 | 438.84 |
mp-1182337 | 6.619175 | 5.916461 | -3.838898 | other | Ba2Cl2O6 | 10 | 1 | 203.72 |
mp-2230039 | 6.549357 | 13.373993 | -2.072238 | other | Mg1Co7O12 | 20 | 1 | 213.48 |
mp-1182530 | 10.690713 | 5.770589 | -4.307778 | other | Fe16H20O34 | 70 | 1 | 698.75 |
mp-698650 | 7.833286 | 11.498036 | 1.257368 | other | Sr13Mn8O30 | 51 | 1 | 820.17 |
mp-1652319 | 7.008291 | 13.138735 | -1.562296 | other | Cd6Co5O15 | 26 | 1 | 322.9 |
mp-673844 | -5.492131 | -1.805196 | -3.482495 | other | Cr1Fe2Se4 | 7 | 1 | 146.24 |
mp-685713 | 10.317548 | 10.682494 | 3.225695 | other | Gd7Ti8O26 | 41 | 1 | 545.11 |
mp-1218901 | 7.92316 | 7.612914 | -4.13512 | other | Sr3U6O28 | 37 | 1 | 576.33 |
mp-998712 | 8.555488 | 1.610133 | 1.218699 | other | Tl1Ge1F3 | 5 | 1 | 105.97 |
mp-758223 | 9.574059 | 8.56738 | -0.753868 | other | Bi11P1O20 | 32 | 1 | 547.35 |
mp-776360 | 1.87533 | 1.75963 | 2.829973 | other | Zr16N16O8 | 40 | 1 | 522.84 |
mp-1409379 | 12.92695 | 10.428499 | 0.137734 | other | Mg1W4O8 | 13 | 1 | 187.85 |
mp-698587 | 10.01797 | 13.059883 | 0.110285 | other | Ti10Ni10O30 | 50 | 1 | 516.75 |
mp-759668 | 10.237481 | 2.443857 | 0.079231 | other | V6O2F22 | 30 | 1 | 417.1 |
mp-1393169 | 10.23777 | 0.516848 | 0.381909 | other | Li2Fe2F8 | 12 | 1 | 151.35 |
mp-780233 | 12.427255 | 11.955442 | 1.839109 | other | Li7Ti14O28 | 49 | 1 | 565.24 |
mp-760068 | 6.960312 | 10.480867 | -0.936322 | other | Na32Co8O32 | 72 | 1 | 1,089.52 |
mp-1221571 | 11.183022 | 8.731153 | -5.737418 | other | Mo2P3O14 | 19 | 1 | 346.88 |
mp-1220106 | -4.313617 | -3.904941 | -3.738059 | other | Pr12Si5Se28 | 45 | 1 | 1,202.98 |
mp-1101003 | 10.33272 | 12.310367 | -4.173478 | other | V18Cu2O45 | 65 | 1 | 1,185.28 |
mp-760929 | 12.838285 | -0.82501 | 0.342542 | other | Mn8O8F8 | 24 | 1 | 273.04 |
mp-1217871 | -2.814546 | -2.520691 | -5.945927 | other | Tb12Si5S28 | 45 | 1 | 961.42 |
mp-754899 | 12.114823 | 3.135615 | 0.969098 | other | V4O3F9 | 16 | 1 | 198.25 |
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